![(2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid structure](/static/products/332/332106-10-2.png)
(2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid
TL;DR: (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid (CAS 332106-10-2) is a chemical compound with molecular formula C16H12BrNO3 and molecular weight 345.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-[(4-bromobenzoyl)amino]-3-phenylprop-2-enoic acid
Also Known As: BAS 01123264, (E)-2-(4-bromobenzamido)-3-phenylacrylic acid, 2-(4-Bromo-benzoylamino)-3-phenyl-acrylic acid, (E)-2-[(4-bromobenzoyl)amino]-3-phenylprop-2-enoic acid, (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid
| Molecular Formula | C16H12BrNO3 |
|---|---|
| Molecular Weight | 345.00 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.00006 |
| Heavy Atoms | 21 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 332106-10-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C(\C(=O)O)/NC(=O)C2=CC=C(C=C2)Br |
| InChIKey | IVYFPQJIEKTYRF-GXDHUFHOSA-N |
Product Overview
(2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid (CAS 332106-10-2), with molecular formula C16H12BrNO3 and molecular weight 345.00 g/mol. IUPAC: (E)-2-[(4-bromobenzoyl)amino]-3-phenylprop-2-enoic acid.
Chemical Property Profile of (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid
Property Insights of (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid. Following Lipinski's Rule of Five, (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid?
The CAS number of (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid is 332106-10-2.
What is the molecular formula of (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid?
The molecular formula of (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid is C16H12BrNO3.
What is the molecular weight of (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid?
The molecular weight of (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid is 345.00 g/mol.
Where can I buy (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid?
You can request a quote for (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[(4-bromophenyl)carbonylamino]-3-phenylprop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.